sodium 5-[(E)-[2-[(4-methylphenyl)amino]ethanoylhydrazinylidene]methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[(E)-[2-[(4-methylphenyl)amino]ethanoylhydrazinylidene]methyl]furan-2-sulfonate Openeye Name: sodium 5-[(E)-[[2-(4-methylanilino)acetyl]hydrazono]methyl]furan-2-sulfonate CAS Name: sodium 5-[(E)-[[2-(4-methylanilino)-1-oxoethyl]hydrazinylidene]methyl]-2-furansulfonate IUPAC Name: sodium 5-[(E)-[[2-(4-methylanilino)acetyl]hydrazinylidene]methyl]furan-2-sulfonate Traditional Name: sodium 5-[(E)-[[2-(p-toluidino)acetyl]hydrazono]methyl]furan-2-sulfonate Formula: C14H14N3NaO5S MolecularWeight: 359.33283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC(=O)NN=CC2=CC=C(O2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)NCC(=O)N/N=C/C2=CC=C(O2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H15N3O5S.Na/c1-10-2-4-11(5-3-10)15-9-13(18)17-16-8-12-6-7-14(22-12)23(19,20)21;/h2-8,15H,9H2,1H3,(H,17,18)(H,19,20,21);/q;+1/p-1/b16-8+;